| SpectraBase Compound ID | vpQMkQN7iC |
|---|---|
| InChI | InChI=1S/C36H58O11/c1-18(16-37)9-8-12-35(6,45)29-21(39)14-33(4)24-11-10-19-20(36(24,7)25(40)15-34(29,33)5)13-22(30(44)32(19,2)3)46-31-28(43)27(42)26(41)23(17-38)47-31/h9-10,20-24,26-31,37-39,41-45H,8,11-17H2,1-7H3/b18-9-/t20-,21-,22+,23+,24+,26+,27-,28+,29+,30+,31+,33+,34-,35?,36+/m1/s1 |
| InChIKey | MWMDOMJSKSLEEM-MHCJJZCLSA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C36H58O11 |
| Exact Mass | 666.397913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HHo13OBn8ch |
|---|---|
| Name | (2-BETA,3-BETA,9-BETA,10-ALPHA,16-ALPHA,20-BETA,24Z)-2-(BETA-D-GLUCOPYRANOSYLOXY)-3,16,20,26-TETRAHYDROXY-9-METHYL-19-NORLANOST-5,24-DIENE-11-ONE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O11 |
| InChI | InChI=1S/C36H58O11/c1-18(16-37)9-8-12-35(6,45)29-21(39)14-33(4)24-11-10-19-20(36(24,7)25(40)15-34(29,33)5)13-22(30(44)32(19,2)3)46-31-28(43)27(42)26(41)23(17-38)47-31/h9-10,20-24,26-31,37-39,41-45H,8,11-17H2,1-7H3/b18-9-/t20-,21-,22+,23+,24+,26+,27-,28+,29+,30+,31+,33+,34-,35?,36+/m1/s1 |
| InChIKey | MWMDOMJSKSLEEM-MHCJJZCLSA-N |
| Literature Reference Author | H.STUPPNER,E.P.MUELLER |
| Literature Reference Citation | PHYTOCHEM.,33,1139(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85038-S |
| Molecular Weight | 666.850 g/mol |
| Solvent | CD3OD |